C31h30n2o7 6h-furo [2 ', 3': 4,5] Oxazoloy-3-hydroxy-7, (2r, 3r, 3r, 3r, 9r) - (9ci, aci)
Thepa ea bohlokoa ea 'mele | Boleng | Boemo |
Boima ba Molecular | 542.58 | - |
Sekhahla sa ho pheha (se boletsoeng esale pele) | 692.9 ± 65.0 ° C | Tobetsa: 760 Torr |
Mabenyane (a boletsoeng esale pele) | 1.33 ± 0.1 g / cm3 | Temp: 20 ° C; Tobetsa: 760 Torr |
pka (e boletsoeng esale pele) | 12.51 ± 0.60 | Boholo ba tempele ea acidic: 25 ° C |
Cannonical Smiles O = C1n = C1C33c (O) c (OC3 = CC4) CC6 = CC = C (OC) C
Imemeric Smiles C (OC [OC @ H] 1O [C @@] 2 (
Inchi
Inchi = 1 / c31h3033 / c1-197 / c1-19-17-33) 25 (39-28) 25 (36-2) 14-10
) 22-11-15-24 (37-3) 16-12-22 / h4-15,25,25,25,25,25,25,25,293, 18h2,1
Senotlolo sa Inchi
Blaqceznlikssh-citkvlssa-n
1 Lebitso le leng bakeng sa ntho ena
(2r, 3r, 3r, 9Ar) -2 - [[12-Methyl-6-hydroxy-7-a]
Spectra e fumanehang
1h nmr
13c nmr
Mass
Thepa e fumanehang |
Sa tlhaho |
Lik'hemik'hale |
Letsoalo |
LIPINSSKI |
Sebopeho se amanang le |
Armal |
Sa tlhaho
Thepa | Boleng | Boemo | Mohloli |
Linkho tsa BioCentration | 2800 | ph 1; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2800 | ph 2; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2800 | ph 3; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2800 | PH 4; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2800 | ph 5; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2800 | PH 6; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2800 | PH 7; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2800 | PH 8; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2800 | ph 9; TEMP: 25 ° C | (1) ACD |
Linkho tsa BioCentration | 2790 | ph 10; TEMP: 25 ° C | (1) ACD |
.
Lik'hemik'hale
Thepa | Boleng | Boemo | Mohloli |
Koc | 10200 | ph 1; TEMP: 25 ° C | (1) ACD |
Koc | 10200 | ph 2; TEMP: 25 ° C | (1) ACD |
Koc | 10200 | ph 3; TEMP: 25 ° C | (1) ACD |
Koc | 10200 | PH 4; TEMP: 25 ° C | (1) ACD |
Koc | 10200 | ph 5; TEMP: 25 ° C | (1) ACD |
Thepa | Boleng | Boemo | Mohloli |
Koc | 10200 | PH 6; TEMP: 25 ° C | (1) ACD |
Koc | 10200 | PH 7; TEMP: 25 ° C | (1) ACD |
Koc | 10200 | PH 8; TEMP: 25 ° C | (1) ACD |
Koc | 10200 | ph 9; TEMP: 25 ° C | (1) ACD |
Koc | 10200 | ph 10; TEMP: 25 ° C | (1) ACD |
logd | 4.84 | ph 1; TEMP: 25 ° C | (1) ACD |
logd | 4.84 | ph 2; TEMP: 25 ° C | (1) ACD |
logd | 4.84 | ph 3; TEMP: 25 ° C | (1) ACD |
logd | 4.84 | PH 4; TEMP: 25 ° C | (1) ACD |
logd | 4.84 | ph 5; TEMP: 25 ° C | (1) ACD |
logd | 4.84 | PH 6; TEMP: 25 ° C | (1) ACD |
logd | 4.84 | PH 7; TEMP: 25 ° C | (1) ACD |
logd | 4.84 | PH 8; TEMP: 25 ° C | (1) ACD |
logd | 4.84 | ph 9; TEMP: 25 ° C | (1) ACD |
logd | 4.84 | ph 10; TEMP: 25 ° C | (1) ACD |
Logp | 4.839 ± 0.618 | TEMP: 25 ° C | (1) ACD |
Mass Interrincic solubility | 3.6 x 10-4 g / l | TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | ph 1; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | ph 2; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | ph 3; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | PH 4; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | ph 5; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | PH 6; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | PH 7; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | PH 8; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | ph 9; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | ph 10; TEMP: 25 ° C | (1) ACD |
Mass Slisedity | 3.6 x 10-4 g / l | Ph ea metsi e sa sebetsoeng 7.00; TEMP: 25 ° C | (1) ACD |
Molala oa Molala oa Molala | 6.6 x 10-7 Mol / L | TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.6 x 10-7 Mol / L | ph 1; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.6 x 10-7 Mol / L | ph 2; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.6 x 10-7 Mol / L | ph 3; TEMP: 25 ° C | (1) ACD |
Thepa | Boleng | Boemo | Mohloli |
Molala ea lla | 6.6 x 10-7 Mol / L | PH 4; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.6 x 10-7 Mol / L | ph 5; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.6 x 10-7 Mol / L | PH 6; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.6 x 10-7 Mol / L | PH 7; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.6 x 10-7 Mol / L | PH 8; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.6 x 10-7 Mol / L | ph 9; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.7 x 10-7 Mol / L | ph 10; TEMP: 25 ° C | (1) ACD |
Molala ea lla | 6.6 x 10-7 Mol / L | Ph ea metsi e sa sebetsoeng 7.00; TEMP: 25 ° C | (1) ACD |
Boima ba Molecular | 542.58 | ||
pka | 12.51 ± 0.60 | Boholo ba tempele ea acidic: 25 ° C | (1) ACD |
pka | -4.38 ± 0.60 | Boholo ba mosebetsi oa mantlha: 25 ° C | (1) ACD |
Khatello ea mouoane | 3.73 x 10-20 Torr | TEMP: 25 ° C | (1) ACD |
.
Letsoalo
Thepa | Boleng | Boemo | Mohloli |
Letsoalo | 1.33 ± 0.1 g / cm3 | Temp: 20 ° C; Tobetsa: 760 Torr | (1) ACD |
Molumo oa Molalar | 404.9 ± 7.0 cm3 / mol | Temp: 20 ° C; Tobetsa: 760 Torr | (1) ACD |
.
LIPINSSKI
Thepa | Boleng | Boemo | Mohloli |
Li-litlama tse potolohileng ka bolokolohi | 9 | (1) ACD | |
H | 9 | (1) ACD | |
H donors | 1 | (1) ACD | |
H donor / Canot | 10 | (1) ACD | |
Logp | 4.839 ± 0.618 | TEMP: 25 ° C | (1) ACD |
Boima ba Molecular | 542.58 |
.
Sebopeho se amanang le
Thepa | Boleng | Boemo | Mohloli |
Sebaka sa polar. | 99.1 A2 | (1) ACD |
.
Armal
Thepa | Boleng | Boemo | Mohloli |
Poleft Point | 692.9 ± 65.0 ° C | Tobetsa: 760 Torr | (1) ACD |
Entatpy ea vaporization | 106.61 ± 3.0 KJ / Mol | Tobetsa: 760 Torr | (1) ACD |
Flash point | 372.8 ± 34.3 ° C | (1) ACD |
.
Spectra e fumanehang
1h nmr
13c nmr
Ngola molaetsa oa hau mona 'me u e romelle ho rona